hex-3-ynyl benzenecarboperoxoate

Systemtic Name: hex-3-ynyl benzenecarboperoxoate Openeye Name: hex-3-ynyl benzenecarboperoxoate CAS Name: benzenecarboperoxoic acid hex-3-ynyl ester IUPAC Name: hex-3-ynyl benzenecarboperoxoate Traditional Name: benzenecarboperoxoic acid hex-3-ynyl ester Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCCOOC(=O)C1=CC=CC=C1

Isomeric SMILES

CCC#CCCOOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H14O3/c1-2-3-4-8-11-15-16-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2,8,11H2,1H3